N-[[3-(phenylmethyl)-1H-imidazol-3-ium-4-yl]methyl]-5-pyridin-2-yl-pyrimidin-2-amine

Systemtic Name: N-[[3-(phenylmethyl)-1H-imidazol-3-ium-4-yl]methyl]-5-pyridin-2-yl-pyrimidin-2-amine Openeye Name: N-[(3-benzyl-1H-imidazol-3-ium-4-yl)methyl]-5-(2-pyridyl)pyrimidin-2-amine CAS Name: N-[[3-(phenylmethyl)-1H-imidazol-3-ium-4-yl]methyl]-5-(2-pyridinyl)-2-pyrimidinamine IUPAC Name: N-[(3-benzyl-1H-imidazol-3-ium-4-yl)methyl]-5-pyridin-2-ylpyrimidin-2-amine Traditional Name: (3-benzyl-1H-imidazol-3-ium-4-yl)methyl-[5-(2-pyridyl)pyrimidin-2-yl]amine Formula: C20H19N6+ MolecularWeight: 343.40506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CNC=C2CNC3=NC=C(C=N3)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CNC=C2CNC3=NC=C(C=N3)C4=CC=CC=N4

InChI

InChI=1S/C20H18N6/c1-2-6-16(7-3-1)14-26-15-21-12-18(26)13-25-20-23-10-17(11-24-20)19-8-4-5-9-22-19/h1-12,15H,13-14H2,(H,22,23,24,25)/p+1